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3-(Ethoxycarbonyl-methyl)-10-decanoic acid, lactone
SpectraBase Compound ID KTlk2On3U3j
InChI InChI=1S/C14H24O4/c1-2-17-13(15)10-12-8-6-4-3-5-7-9-18-14(16)11-12/h12H,2-11H2,1H3
InChIKey SBISPXGVSSVWOG-UHFFFAOYSA-N
Mol Weight 256.34 g/mol
Molecular Formula C14H24O4
Exact Mass 256.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1jHrA5aCnTB
Name 3-(Ethoxycarbonyl-methyl)-10-decanoic acid, lactone
Comments C2-SHIFT IS CHANGED FROM 26.32 PPM TO 36.32 PPM
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Formula C14H24O4
InChI InChI=1S/C14H24O4/c1-2-17-13(15)10-12-8-6-4-3-5-7-9-18-14(16)11-12/h12H,2-11H2,1H3
InChIKey SBISPXGVSSVWOG-UHFFFAOYSA-N
Literature Reference N.A. Porter, V.H.T. Chang, J. Am. Chem. Soc. 109, 4976 (1987).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3